Hydrazinecarboxylic acid, (cyanophenylmethylene)-, ethyl ester
Basic information
- CAS
61766-66-3- Standard SMILES
CCOC(=O)NN=C(C#N)c1ccccc1- InChIKey
VFHMFSZFAJINJW-UHFFFAOYSA-N- Molecular formula
- C11H11N3O2
- Average molar mass
- 217.22 g/mol
- Monoisotopic mass
- 217.0851266
Names & identifiers
- Preferred name
- Hydrazinecarboxylic acid, (cyanophenylmethylene)-, ethyl ester
- IUPAC
- ethyl N-[[cyano(phenyl)methylidene]amino]carbamate
Names & synonyms
61766-66-3Hydrazinecarboxylic acid, (cyanophenylmethylene)-, ethyl esterDTXSID80398811Ethyl 2-[cyano(phenyl)methylidene]hydrazine-1-carboxylate
Database identifiers
- CAS
61766-66-3- PubChem CID
- 4054489
- DTXSID
DTXSID80398811
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 310
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Compound notes
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